Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | MKNK1 | Q9BUB5 | 4/20 | 0.60 |
| ▸ | MKNK2 | Q9HBH9 | 4/20 | 0.60 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.52 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.52 |
| ▸ | KIF11 | P52732 | 1/20 | 0.52 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.52 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Biphenyl SCHEMBL28338714 | 0.91 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL29500136 | 0.91 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL16405704 | 0.91 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL141605 | 0.91 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL31124557 | 0.88 | CYP2A6 (0.79) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL32679826 | 0.88 | CYP2A6 (0.79) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL3400752 | 0.88 | CYP2A6 (0.79) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL29468039 | 0.88 | CYP2A6 (0.79) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL30963953 | 0.88 | CYP2A6 (0.79) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL31588397 | 0.88 | CYP2A6 (0.79) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111187201-A | Compound and organic electroluminescent device | 清华大学 | 2020-05-22 | — | — | CN | disclosed |
| US-20060058178-A1 | Aromatic compounds containing nitrogen and p- functionalized amines, the production thereof and their use in catalytic reactions | DEGUSSA AG (DE) | 2006-03-16 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20060058178-A1 | Aromatic compounds containing nitrogen and p- functionalized amines, the production thereof and their use in catalytic reactions | PAH, PNMT, TYR | CYP2A6 661/4885ALDH1A1 1612/4885CYP1A2 80/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.